COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK808566
Chemical Name: ethyl2-({[2,2,2-trichloro-1-(propanoylamino)ethyl]carbamothioyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=S)NC(C(Cl)(Cl)Cl)NC(=O)CC)sc2c1CCCC2

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Molecular Weight: 486.87
Empirical Formula: C17H22Cl3N3O3S2

Physical State: Dry powder
Available Amount: 98 mg

Lipinsky:
logP: 6.864
Rotatable bonds: 6
H-donors: 3
H-acceptors: 3
PSA: 139
Number of rings: 2

     

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